N-isoquinolin-3-yl-4-(pyridin-4-ylmethylamino)pyrimidine-5-carboxamide

Systemtic Name: N-isoquinolin-3-yl-4-(pyridin-4-ylmethylamino)pyrimidine-5-carboxamide Openeye Name: N-(3-isoquinolyl)-4-(4-pyridylmethylamino)pyrimidine-5-carboxamide CAS Name: N-(3-isoquinolinyl)-4-(pyridin-4-ylmethylamino)-5-pyrimidinecarboxamide IUPAC Name: N-isoquinolin-3-yl-4-(pyridin-4-ylmethylamino)pyrimidine-5-carboxamide Traditional Name: N-(3-isoquinolyl)-4-(4-pyridylmethylamino)pyrimidine-5-carboxamide Formula: C20H16N6O MolecularWeight: 356.38064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)NC(=O)C3=CN=CN=C3NCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)NC(=O)C3=CN=CN=C3NCC4=CC=NC=C4

InChI

InChI=1S/C20H16N6O/c27-20(26-18-9-15-3-1-2-4-16(15)11-23-18)17-12-22-13-25-19(17)24-10-14-5-7-21-8-6-14/h1-9,11-13H,10H2,(H,22,24,25)(H,23,26,27)